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4 papers · 1 filter
Abinit 2025: New Capabilities for the Predictive Modeling of Solids and Nanomaterials
Matthieu J. Verstraete, Joao Abreu, Guillaume E. Allemand +71
Abinit is a widely used scientific software package implementing density functional theory and many related functionalities for excited states and response properties. This paper p…
Tuning electronic and optical properties of 2D polymeric C by stacking two layers
Dylan Shearsby, Jiaqi Wu, Dekun Yang +1
Benefiting from improved stability due to stronger interlayer van der Waals interactions, few-layer fullerene networks are experimentally more accessible compared to monolayer poly…
Ultra-fast Digital DPC Yielding High Spatio-Temporal Resolution for Low-Dose Phase Characterisation
Julie Marie Bekkevold, Jonathan J. P. Peters, Ryo Ishikawa +2
In the scanning transmission electron microscope, both phase imaging of beam-sensitive materials and characterisation of a material's functional properties using in-situ experiment…
Nearly perfect spin polarization of noncollinear antiferromagnets
Gautam Gurung, Mohamed Elekhtiar, Qing-Qing Luo Ding-Fu Shao +1
Ferromagnets with high spin polarization are known to be valuable for spintronics--a research field that exploits the spin degree of freedom in information technologies. Recently,…